Geometry & MOs

Info

ID:	29192
PubChem CID:	832263
Reduced:	N2O2C5H9 (2)
Stoich.:	A2B2C5D9 (2)
Weight, g/mol:	242.105528
ΔH_f, kcal/mol:	-182.19
Dipole, Da:	3.38
IP(EA), eV:	-9.93(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-1,5,6,7-tetrahydrobenzimidazol-4-one

Drug info:

PubChemData

Smile

CCN1[C@H]2[C@@H](N(C1=O)CC)N(C(=O)N2CO)CO

DOS

IR

Vibrations